2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxypyridin-4-yl)methylamino]-3H-isoindol-1-one

Systemtic Name: 2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxypyridin-4-yl)methylamino]-3H-isoindol-1-one Openeye Name: 2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxy-4-pyridyl)methylamino]isoindolin-1-one CAS Name: 2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxy-4-pyridinyl)methylamino]-3H-isoindol-1-one IUPAC Name: 2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxypyridin-4-yl)methylamino]-3H-isoindol-1-one Traditional Name: 2-(5-tert-butyl-1H-pyrazol-3-yl)-7-[(2-methoxy-4-pyridyl)methylamino]isoindolin-1-one Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC(=NC=C4)OC

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)N2CC3=C(C2=O)C(=CC=C3)NCC4=CC(=NC=C4)OC

InChI

InChI=1S/C22H25N5O2/c1-22(2,3)17-11-18(26-25-17)27-13-15-6-5-7-16(20(15)21(27)28)24-12-14-8-9-23-19(10-14)29-4/h5-11,24H,12-13H2,1-4H3,(H,25,26)